3-azanyl-N-(4-methyl-1-oxidanyl-pentan-2-yl)-4-(4-methylsulfonylphenyl)-2-oxidanyl-butanamide

Systemtic Name: 3-azanyl-N-(4-methyl-1-oxidanyl-pentan-2-yl)-4-(4-methylsulfonylphenyl)-2-oxidanyl-butanamide Openeye Name: 3-amino-2-hydroxy-N-[1-(hydroxymethyl)-3-methyl-butyl]-4-(4-methylsulfonylphenyl)butanamide CAS Name: 3-amino-2-hydroxy-N-(1-hydroxy-4-methylpentan-2-yl)-4-(4-methylsulfonylphenyl)butanamide IUPAC Name: 3-amino-2-hydroxy-N-(1-hydroxy-4-methylpentan-2-yl)-4-(4-methylsulfonylphenyl)butanamide Traditional Name: 3-amino-2-hydroxy-4-(4-mesylphenyl)-N-(3-methyl-1-methylol-butyl)butyramide Formula: C17H28N2O5S MolecularWeight: 372.47962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CO)NC(=O)C(C(CC1=CC=C(C=C1)S(=O)(=O)C)N)O

Isomeric SMILES

CC(C)CC(CO)NC(=O)C(C(CC1=CC=C(C=C1)S(=O)(=O)C)N)O

InChI

InChI=1S/C17H28N2O5S/c1-11(2)8-13(10-20)19-17(22)16(21)15(18)9-12-4-6-14(7-5-12)25(3,23)24/h4-7,11,13,15-16,20-21H,8-10,18H2,1-3H3,(H,19,22)